N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3O2S/c1-15-16(2)28-22(19(15)14-23)24-21(27)18-10-12-25(13-11-18)20(26)9-8-17-6-4-3-5-7-17/h3-9,18H,10-13H2,1-2H3,(H,24,27)/b9-8+